ethyl 4-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methylamino]benzoate

Systemtic Name: ethyl 4-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methylamino]benzoate Openeye Name: ethyl 4-[(2-thioxo-1,3-benzoxazol-3-yl)methylamino]benzoate CAS Name: 4-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methylamino]benzoate Traditional Name: 4-[(2-thioxo-1,3-benzoxazol-3-yl)methylamino]benzoic acid ethyl ester Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NCN2C3=CC=CC=C3OC2=S

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NCN2C3=CC=CC=C3OC2=S

InChI

InChI=1S/C17H16N2O3S/c1-2-21-16(20)12-7-9-13(10-8-12)18-11-19-14-5-3-4-6-15(14)22-17(19)23/h3-10,18H,2,11H2,1H3